Vitas-M small molecule compound
5-[(4-{(1E)-1-[2-(1,3-benzodioxol-5-ylcarbonyl)hydrazinylidene]ethyl}phenyl)amino]-5-oxopentanoic acid
Catalog ID
STK380059
SMILES OC(=O)CCCC(=O)Nc1ccc(cc1)/C(=N/NC(=O)c1ccc2c(c1)OCO2)/C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C21H21N3O6 MW 411.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O6/c1-13(23-24-21(28)15-7-10-17-18(11-15)30-12-29-17)14-5-8-16(9-6-14)22-19(25)3-2-4-20(26)27/h5-11H,2-4,12H2,1H3,(H,22,25)(H,24,28)(H,26,27)/b23-13+InChIKey
PMQDWERNWXTNKR-YDZHTSKRSA-NSynonyms
6131-58-44(N(4((1E)2(2HBENZO(34D)13DIOXOLEN5YLCARBONYLAMINO)1METHYL2AZAVINYL)PHENYL)CARBAMOYL)BUTANOICACID
5((4((1E)1(2(13benzodioxol5ylcarbonyl)hydrazinylidene)ethyl)phenyl)amino)5oxopentanoicacid
5(4((E)N(13BENZODIOXOLE5CARBONYLAMINO)CMETHYLCARBONIMIDOYL)ANILINO)5OXOPENTANOICACID
6131584
CC(=NNC(=O)C1=CC2=C(C=C1)OCO2)C3=CC=C(C=C3)NC(=O)CCCC(=O)O
InChI=1SC21H21N3O6c113(232421(28)157101718(1115)30122917)145816(9614)2219(25)32420(26)27h511H2412H21H3(H2225)(H2428)(H2627)b2313+
MFCD01993834
OC(=O)CCCC(=O)Nc1ccc(cc1)C(=NNC(=O)c1ccc2c(c1)OCO2)C
ZINC000004507176
ZINC12378965
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